(E)-3-(10-methoxy-8-oxidanylidene-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(10-methoxy-8-oxidanylidene-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)prop-2-enoic acid Openeye Name: (E)-3-(10-methoxy-8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)prop-2-enoic acid CAS Name: (E)-3-(10-methoxy-8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)-2-propenoic acid IUPAC Name: (E)-3-(10-methoxy-8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-13-yl)prop-2-enoic acid Traditional Name: (E)-3-(8-keto-10-methoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-13-yl)acrylic acid Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C3C4=CC=CC=C4CCN3C2=O)C=CC(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C3C4=CC=CC=C4CCN3C2=O)/C=C/C(=O)O

InChI

InChI=1S/C21H17NO4/c1-26-14-6-7-16-17(8-9-19(23)24)20-15-5-3-2-4-13(15)10-11-22(20)21(25)18(16)12-14/h2-9,12H,10-11H2,1H3,(H,23,24)/b9-8+